SCHEMBL4020293

SCHEMBL4020293

Cc1c(F)cccc1C1[C@@H](C(=O)c2cccc(O)c2)CN(C[C@H](CO)NC2CCCC2)C[C@@H]1C(=O)c1cccc(O)c1

nearest known ligand 0.37

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
GNRHR P30968 3/20 0.37
MGLL Q99685 9/20 0.32
KDM2B Q8NHM5 3/20 0.32
ACKR3 P25106 1/20 0.32
ALDH1A1 P00352 1/20 0.31
ROCK2 O75116 1/20 0.30

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL4749185 0.89 KDM2B (0.31) MGLLKDM2B
SCHEMBL4749198 0.86 MEN1 (0.33) MGLLKDM2B
SCHEMBL4018647 0.84 KDM2B (0.33) MGLLKDM2BALDH1A1
SCHEMBL4020603 0.83 KDM2B (0.33) MGLLKDM2BALDH1A1
SCHEMBL4022530 0.82 KDM2B (0.34) MGLLKDM2BALDH1A1
SCHEMBL4023878 0.82 KDM2B (0.34) MGLLKDM2BALDH1A1
SCHEMBL13721304 0.82 KDM2B (0.34) MGLLKDM2BALDH1A1
SCHEMBL4020419 0.82 KDM2B (0.32) MGLLKDM2B
SCHEMBL4026401 0.81 SLC6A2 (0.31) MGLLKDM2B
SCHEMBL4752836 0.80 OPRM1 (0.32) MGLLKDM2B

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7572814-B2 3,5-dibenzoyl-4-phenyl-piperidine anti-cancer compounds CYTOKINETICS, INCORPORATED (US) 2009-08-11 US claimed
US-7572814-B2 3,5-dibenzoyl-4-phenyl-piperidine anti-cancer compounds CYTOKINETICS, INCORPORATED (US) 2009-08-11 US disclosed
US-20070161674-A1 Certain chemical entities, compositions, and methods CYTOKINETICS, INC. 2007-07-12 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20070161674-A1 Certain chemical entities, compositions, and methods TP53, VHL, RB1 GNRHR 3715/4885MGLL 2929/4885KDM2B 3090/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.